SCHEMBL20749281

SCHEMBL20749281

CCCCc1ccc(Cl)cc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTRC Q99895 1/20 0.44
TYR P14679 3/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
SKP2 Q13309 1/20 0.39
ADORA3 P0DMS8 4/20 0.39
IDH1 O75874 1/20 0.39
SIRT1 Q96EB6 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP3A4 P08684 2/20 0.38
TP53 P04637 1/20 0.38
ALOX5 P09917 1/20 0.38
MAPT P10636 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CCNB2 O95067 1/20 0.38
CDK1 P06493 1/20 0.38
CCNB1 P14635 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21982508 0.92 TYR (0.47) CTRCTYRMEN1KMT2ASIRT1
SCHEMBL8337975 0.88 CYP3A4 (0.40) SMN1; SMN2CYP3A4TSHR
SCHEMBL22791630 0.84 MEN1 (0.42) CTRCTYRMEN1KMT2ASKP2
SCHEMBL12226956 0.82 HDAC3 (0.38) MEN1KMT2ASMN1; SMN2CYP3A4TP53
SCHEMBL6681310 0.82 IDO1 (0.52) CTRCTYRMEN1KMT2ACYP3A4
SCHEMBL23188852 0.81 GAA (0.47) SIRT1TP53ALOX15
SCHEMBL5838107 0.79 TYR (0.47) CTRCTYRMEN1KMT2ASKP2
SCHEMBL5187389 0.79 HIF1A (0.50) TYRMEN1KMT2ASMN1; SMN2CYP3A4
SCHEMBL171203 0.79 CYP3A4 (0.43) CTRCCYP3A4
SCHEMBL11683860 0.78 TYR (0.67) CTRCTYRMEN1KMT2ASMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2968211-B1 PHENYL ALKYL CARBAMATE COMPOUNDS FOR USE IN PREVENTING OR TREATING EPILEPSY OR EPILEPSY-RELATED SYNDROME BIO PHARM SOLUTIONS CO LTD (KR) 2021-05-12 EP disclosed
WO-2020252205-A1 INHIBITORS OF INTEGRATED STRESS RESPONSE PATHWAY Praxis Biotech LLC (US) 2020-12-17 WO disclosed
EP-3443959-A1 SULFAMATE DERIVATIVE COMPOUNDS FOR USE IN TREATING OR ALLEVIATING PAIN Bio-Pharm Solutions Co., Ltd. (KR) 2019-02-20 EP disclosed